[4-[(thiophen-2-ylmethylamino)methyl]phenyl]methanol

C13H15NOS — CID 83962635

IUPAC[4-[(thiophen-2-ylmethylamino)methyl]phenyl]methanol
SMILESOCc1ccc(CNCc2cccs2)cc1
InChIInChI=1S/C13H15NOS/c15-10-12-5-3-11(4-6-12)8-14-9-13-2-1-7-16-13/h1-7,14-15H,8-10H2
InChIKeyPTNAZAICFFNMDM-UHFFFAOYSA-N
MW233.34 g/mol
LogP2.53
Rot. Bonds5

About [4-[(thiophen-2-ylmethylamino)methyl]phenyl]methanol

[4-[(thiophen-2-ylmethylamino)methyl]phenyl]methanol (PubChem CID 83962635) has the molecular formula C13H15NOS and a molecular weight of 233.34 g/mol. Its IUPAC name is [4-[(thiophen-2-ylmethylamino)methyl]phenyl]methanol.

Molecular Properties

Compound Name[4-[(thiophen-2-ylmethylamino)methyl]phenyl]methanol
PubChem CID83962635
Molecular FormulaC13H15NOS
Molecular Weight233.34 g/mol
Exact Mass233.09
IUPAC Name[4-[(thiophen-2-ylmethylamino)methyl]phenyl]methanol
SMILESOCc1ccc(CNCc2cccs2)cc1
InChIInChI=1S/C13H15NOS/c15-10-12-5-3-11(4-6-12)8-14-9-13-2-1-7-16-13/h1-7,14-15H,8-10H2
InChIKeyPTNAZAICFFNMDM-UHFFFAOYSA-N
XLogP2.53
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.34
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[3-[(thiophen-2-ylmethylamino)methyl]phenyl]methanol;hydrochloride
CID 115615873
2-[4-[(thiophen-2-ylmethylamino)methyl]phenoxy]ethanol
CID 17213242
1-(4-ethoxyphenyl)-N-(thiophen-2-ylmethyl)methanamine
CID 834212
N-[(3,5-dichlorophenyl)methyl]-1-thiophen-2-ylmethanamine
CID 54798944
1-(1H-pyrrol-3-yl)-N-(thiophen-2-ylmethyl)methanamine
CID 66407617
1-[4-(2-methylpropoxy)phenyl]-N-(thiophen-2-ylmethyl)methanamine
CID 54798957
2-methyl-5-[(thiophen-2-ylmethylamino)methyl]aniline
CID 61150338
1-(3-fluorophenyl)-N-(thiophen-2-ylmethyl)methanamine
CID 28668397
[3-[(thiophen-2-ylmethylamino)methyl]phenyl]methanamine
CID 115212986
1-[4-[(4-chlorophenyl)methoxy]phenyl]-N-(thiophen-2-ylmethyl)methanamine;hydrochloride
CID 17290311
[4-chloro-3-(thiophen-2-ylmethylamino)phenyl]methanol
CID 115877219
1-(3-methoxy-4-methylphenyl)-N-(thiophen-2-ylmethyl)methanamine
CID 54883860

Frequently Asked Questions

What is the IUPAC name of [4-[(thiophen-2-ylmethylamino)methyl]phenyl]methanol?
The IUPAC name of [4-[(thiophen-2-ylmethylamino)methyl]phenyl]methanol (CID 83962635) is [4-[(thiophen-2-ylmethylamino)methyl]phenyl]methanol.
What is the SMILES notation for [4-[(thiophen-2-ylmethylamino)methyl]phenyl]methanol?
The canonical SMILES for [4-[(thiophen-2-ylmethylamino)methyl]phenyl]methanol is OCc1ccc(CNCc2cccs2)cc1.
What is the InChIKey of [4-[(thiophen-2-ylmethylamino)methyl]phenyl]methanol?
The InChIKey is PTNAZAICFFNMDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NOS/c15-10-12-5-3-11(4-6-12)8-14-9-13-2-1-7-16-13/h1-7,14-15H,8-10H2.
What are the key properties of [4-[(thiophen-2-ylmethylamino)methyl]phenyl]methanol?
[4-[(thiophen-2-ylmethylamino)methyl]phenyl]methanol has a molecular weight of 233.34 g/mol, XLogP of 2.53, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(thiophen-2-ylmethylamino)methyl]phenyl]methanol is sourced from PubChem (CID 83962635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).